3-Fluoro-4-hydroxybenzoic acid

CAT: 0127-PC7964-01Size: 5 gDry Ice: NoHazardous: No

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CAT#:0127-PC7964-01Size:5 g

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CAS Number

350-29-8

Synonyms

4-Carboxy-2-fluorophenol

MDL Number

MFCD00143161

Purity

=95%

Smiles

OC(=O)c1ccc(O)c(F)c1

Chemical Information

3-Fluoro-4-hydroxybenzoic acid

CAS Number	350-29-8
PubChem CID	160456
IUPAC Name	3-fluoro-4-hydroxybenzoic acid
Molecular Formula	C7H5FO3
Molecular Weight	156.11
XLogP	1.6
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	160

SMILES

C1=CC(=C(C=C1C(=O)O)F)O

InChI

InChI=1S/C7H5FO3/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3,9H,(H,10,11)

InChIKey

IUSDEKNMCOUBEE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 350-29-8

CID: 160456

Formula: C7H5FO3

MW: 156.11

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	156.11
XLogP3	1.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	156.02227218
Monoisotopic Mass	156.02227218
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	160
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
PC7701-01	4-Fluoro-3-hydroxybenzoic acid
PC5723-01	4-Fluoro-2-hydroxybenzoic acid
PC9958-01	2-Fluoro-4-hydroxybenzoic acid
PC1004693-01	4-Bromo-2-fluoro-3-hydroxybenzoic acid
PC1025392-01	3-Chloro-4-fluoro-5-hydroxybenzoic acid
PC1012753-01	3-Bromo-2-fluoro-4-hydroxybenzoic acid
PC1022310-01	4-Chloro-2-fluoro-3-hydroxybenzoic acid
PC109999-01	3-Chloro-5-fluoro-4-hydroxybenzoic acid
PC1002780-01	4-Chloro-3-fluoro-2-hydroxybenzoic acid
PC51165-01	4-Bromo-3-fluoro-2-hydroxybenzoic acid

Catalog	Name
276615-01	3-Fluoro-4-hydroxybenzoic acid
sc-232696	4-Fluoro-3-hydroxybenzoic acid
LAC95812-01	4- (4-Fluoro-3-methoxyphenyl) -3-hydroxybenzoic acid
FF07773-01	2-Fluoro-4-hydroxybenzoic acid
432271-01	4-Fluoro-2-hydroxybenzoic acid
ARB12744-01	3-Amino-5-fluoro-4-hydroxybenzoic acid
423779-01	3-Amino-4-fluoro-5-hydroxybenzoic Acid
TRC-C375053-25MG	3-chloro-5-fluoro-4-hydroxybenzoic Acid
FF66743	3-Fluoro-4-hydroxybenzoic acid ethyl ester
FF13992-01	3-Fluoro-4-hydroxybenzoic acid methyl ester